SCHEMBL8471690

SCHEMBL8471690

CC(C)(C)OC(=O)N1C(=O)CC[C@H]1COc1ccc(OC(=O)CCc2cc3cc(C#N)ccc3s2)cc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.34
IRAK4 Q9NWZ3 1/20 0.32
ALK Q9UM73 1/20 0.31
CETP P11597 2/20 0.31
GRM2 Q14416 1/20 0.31
EGLN2 Q96KS0 1/20 0.30
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8472880 0.85 GPR119 (0.41) GPR119IRAK4
SCHEMBL7387070 0.82 GPR119 (0.34) GPR119IRAK4CETP
SCHEMBL8469683 0.81 GPR119 (0.57) GPR119ALKCETP
SCHEMBL8472255 0.77 GPR119 (0.39) GPR119ALKCETP
SCHEMBL8470765 0.76 KDM4E (0.44) IRAK4CCNCCDK8
SCHEMBL8470397 0.75 GPR119 (0.50) GPR119ALKCETP
SCHEMBL8469556 0.73 GPR119 (0.51) GPR119ALKCETP
SCHEMBL7494981 0.71 SSTR4 (0.39) GPR119
SCHEMBL8472119 0.70 GPR119 (0.40) GPR119IRAK4
SCHEMBL7388469 0.69 GPR119 (0.40) GPR119IRAK4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962695-A ANTICOAGULANT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5866577-A AN ANTICOAGULANT AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-02-02 US disclosed